1-[1-(4-chloro-3-nitrophenyl)-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl]-2-phenylethan-1-one
Chemical Structure Depiction of
1-[1-(4-chloro-3-nitrophenyl)-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl]-2-phenylethan-1-one
1-[1-(4-chloro-3-nitrophenyl)-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl]-2-phenylethan-1-one
Compound characteristics
| Compound ID: | 8017-7741 |
| Compound Name: | 1-[1-(4-chloro-3-nitrophenyl)-6-methoxy-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl]-2-phenylethan-1-one |
| Molecular Weight: | 475.93 |
| Molecular Formula: | C26 H22 Cl N3 O4 |
| Smiles: | COc1ccc2c(c1)c1CCN(C(c3ccc(c(c3)[N+]([O-])=O)[Cl])c1[nH]2)C(Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6206 |
| logD: | 5.6206 |
| logSw: | -6.145 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.169 |
| InChI Key: | XXBMSCULCIZYAH-AREMUKBSSA-N |